N3-[3-(1,3-benzothiazol-2-ylamino)phenyl]benzene-1,3-disulfonamide

Systemtic Name: N3-[3-(1,3-benzothiazol-2-ylamino)phenyl]benzene-1,3-disulfonamide Openeye Name: N3-[3-(1,3-benzothiazol-2-ylamino)phenyl]benzene-1,3-disulfonamide CAS Name: N3-[3-(1,3-benzothiazol-2-ylamino)phenyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-[3-(1,3-benzothiazol-2-ylamino)phenyl]benzene-1,3-disulfonamide Traditional Name: N'-[3-(1,3-benzothiazol-2-ylamino)phenyl]benzene-1,3-disulfonamide Formula: C19H16N4O4S3 MolecularWeight: 460.54974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC(=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC(=C4)S(=O)(=O)N

InChI

InChI=1S/C19H16N4O4S3/c20-29(24,25)15-7-4-8-16(12-15)30(26,27)23-14-6-3-5-13(11-14)21-19-22-17-9-1-2-10-18(17)28-19/h1-12,23H,(H,21,22)(H2,20,24,25)